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BioLiP Library

PDB CCD ID: 7G3
Number of entries in BioLiP: 2
Chemical formula: C13 H11 N O3
InChI: InChI=1S/C13H11NO3/c15-12-4-1-9(2-5-12)10-3-6-13(16)11(7-10)8-14-17/h1-8,15-17H/b14-8-
InChIKey: INQGQXOIWVULMW-ZSOIEALJSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01Oc2ccc(c1cc(\C=N/O)c(O)cc1)cc2
OpenEye OEToolkits 2.0.6c1cc(ccc1c2ccc(c(c2)C=NO)O)O
OpenEye OEToolkits 2.0.6c1cc(ccc1c2ccc(c(c2)/C=N\O)O)O
CACTVS 3.385ON=Cc1cc(ccc1O)c2ccc(O)cc2
CACTVS 3.385O\N=C/c1cc(ccc1O)c2ccc(O)cc2
Name:3-[(Z)-(hydroxyimino)methyl][1,1'-biphenyl]-4,4'-diol
ZINC: ZINC000584905390
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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